N-(4-ethylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
N-(4-ethylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C128-0115 |
| Compound Name: | N-(4-ethylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 397.48 |
| Molecular Formula: | C25 H23 N3 O2 |
| Smiles: | CCc1ccc(cc1)NC(c1cnc(c2ccccc12)Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7593 |
| logD: | 5.7557 |
| logSw: | -5.6113 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.292 |
| InChI Key: | IVXRGCNWDUFIAT-UHFFFAOYSA-N |